Benzenemethanamine,2-(1H-pyrrol-1-yl)- supplier

Name
2-(1-PYRROLYL)BENZYLAMINE
EINECS
CAS No. 39243-88-4
Article Data3
CAS DataBase
Density 1.07 g/cm³
Solubility
Melting Point 156 °C
Formula C₁₁H₁₂N₂
Boiling Point 317.2 °C at 760 mmHg
Molecular Weight 172.23
Flash Point 145.6 °C
Transport Information
Appearance
Safety 26-39
Risk Codes 37/38-41
Molecular Structure
Hazard Symbols C,Xi
Synonyms 1-[2-(1H-Pyrrol-1-yl)phenyl]methanamine;1-[2-(Aminomethyl)phenyl]pyrrole;2-(1H-Pyrrol-1-yl)benzenemethanamine;[2-(Pyrrol-1-yl)benzyl]amine;
PSA 30.95000
LogP 2.63630

Benzenemethanamine,2-(1H-pyrrol-1-yl)- Specification

The Benzenemethanamine,2-(1H-pyrrol-1-yl)- is an organic compound with the formula C₁₁H₁₂N₂. The systematic name of this chemical is 1-[2-(1H-pyrrol-1-yl)phenyl]methanamine. With the CAS registry number 39243-88-4, it is also named as [2-(1H-pyrrol-1-yl)phenyl]methylamine. The product's categories are Aminomethyl's; Phenyls & Phenyl-Het.

Physical properties about Benzenemethanamine,2-(1H-pyrrol-1-yl)- are: (1)ACD/LogP: 1.95; (2)#H bond acceptors: 2; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 3; (5)Polar Surface Area: 8.17 Å²; (6)Index of Refraction: 1.589; (7)Molar Refractivity: 54.01 cm³; (8)Molar Volume: 160.1 cm³; (9)Polarizability: 21.41×10^-24cm³; (10)Surface Tension: 43.2 dyne/cm; (11)Density: 1.07 g/cm³; (12)Flash Point: 145.6 °C; (13)Enthalpy of Vaporization: 55.86 kJ/mol; (14)Boiling Point: 317.2 °C at 760 mmHg; (15)Vapour Pressure: 0.000391 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(c(cc1)n2cccc2)CN
(2)InChI: InChI=1/C11H12N2/c12-9-10-5-1-2-6-11(10)13-7-3-4-8-13/h1-8H,9,12H2
(3)InChIKey: BNDYBXDAGIQWOB-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C11H12N2/c12-9-10-5-1-2-6-11(10)13-7-3-4-8-13/h1-8H,9,12H2
(5)Std. InChIKey: BNDYBXDAGIQWOB-UHFFFAOYSA-N

Product Name

2-(1-PYRROLYL)BENZYLAMINE

Benzenemethanamine,2-(1H-pyrrol-1-yl)- Specification

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